(2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol

C14H27NO3 — CID 140917778

IUPAC(2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol
SMILESCC1CCCCC1OC[C@H](O)CN1CCOCC1
InChIInChI=1S/C14H27NO3/c1-12-4-2-3-5-14(12)18-11-13(16)10-15-6-8-17-9-7-15/h12-14,16H,2-11H2,1H3/t12?,13-,14?/m1/s1
InChIKeyRPBHLZDSDYEBKJ-ROKHWSDSSA-N
MW257.37 g/mol
LogP1.27
Rot. Bonds5

About (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol

(2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol (PubChem CID 140917778) has the molecular formula C14H27NO3 and a molecular weight of 257.37 g/mol. Its IUPAC name is (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol
PubChem CID140917778
Molecular FormulaC14H27NO3
Molecular Weight257.37 g/mol
Exact Mass257.20
IUPAC Name(2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol
SMILESCC1CCCCC1OC[C@H](O)CN1CCOCC1
InChIInChI=1S/C14H27NO3/c1-12-4-2-3-5-14(12)18-11-13(16)10-15-6-8-17-9-7-15/h12-14,16H,2-11H2,1H3/t12?,13-,14?/m1/s1
InChIKeyRPBHLZDSDYEBKJ-ROKHWSDSSA-N
XLogP1.27
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.37
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol (CID 140917778) is (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol is CC1CCCCC1OC[C@H](O)CN1CCOCC1.
What is the InChIKey of (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol?
The InChIKey is RPBHLZDSDYEBKJ-ROKHWSDSSA-N. The full InChI is InChI=1S/C14H27NO3/c1-12-4-2-3-5-14(12)18-11-13(16)10-15-6-8-17-9-7-15/h12-14,16H,2-11H2,1H3/t12?,13-,14?/m1/s1.
What are the key properties of (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol?
(2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol has a molecular weight of 257.37 g/mol, XLogP of 1.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-methylcyclohexyl)oxy-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 140917778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).